3-(azepan-1-yl)-8-methyl-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Chemical Structure Depiction of
3-(azepan-1-yl)-8-methyl-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
3-(azepan-1-yl)-8-methyl-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Compound characteristics
| Compound ID: | J030-1001 |
| Compound Name: | 3-(azepan-1-yl)-8-methyl-2-(4-methylpiperidine-1-sulfonyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one |
| Molecular Weight: | 483.63 |
| Molecular Formula: | C26 H33 N3 O4 S |
| Smiles: | CC1CCN(CC1)S(c1cc2C(Nc3cc(C)ccc3Oc2cc1N1CCCCCC1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4866 |
| logD: | 5.4405 |
| logSw: | -5.2757 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.534 |
| InChI Key: | IZTRULPXSYMAFK-UHFFFAOYSA-N |